4-(6-chloranylpyridin-3-yl)carbonyl-N-(2-methylpropyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(6-chloranylpyridin-3-yl)carbonyl-N-(2-methylpropyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-(6-chloropyridine-3-carbonyl)-N-isobutyl-1,4-diazepane-1-carboxamide CAS Name: 4-[(6-chloro-3-pyridinyl)-oxomethyl]-N-(2-methylpropyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-(6-chloropyridine-3-carbonyl)-N-(2-methylpropyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-(6-chloronicotinoyl)-N-isobutyl-1,4-diazepane-1-carboxamide Formula: C16H23ClN4O2 MolecularWeight: 338.83242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)N1CCCN(CC1)C(=O)C2=CN=C(C=C2)Cl

Isomeric SMILES

CC(C)CNC(=O)N1CCCN(CC1)C(=O)C2=CN=C(C=C2)Cl

InChI

InChI=1S/C16H23ClN4O2/c1-12(2)10-19-16(23)21-7-3-6-20(8-9-21)15(22)13-4-5-14(17)18-11-13/h4-5,11-12H,3,6-10H2,1-2H3,(H,19,23)